4-chloro-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-chloro-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide
4-chloro-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | V022-1831 |
| Compound Name: | 4-chloro-N-(2-{4-[(4-chloro-3-methylphenoxy)methyl]-6,7-dihydrothieno[3,2-c]pyridin-5(4H)-yl}-2-oxoethyl)-N-(3-methoxypropyl)benzene-1-sulfonamide |
| Molecular Weight: | 597.58 |
| Molecular Formula: | C27 H30 Cl2 N2 O5 S2 |
| Smiles: | Cc1cc(ccc1[Cl])OCC1c2ccsc2CCN1C(CN(CCCOC)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2774 |
| logD: | 6.2774 |
| logSw: | -6.1503 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.771 |
| InChI Key: | JESPCVHZBSCSBC-VWLOTQADSA-N |